Physical and Quantitative Biology, BME/CHE/PHY 558

Fall 2020 / MWF 10:30 – 11:25 AM  online via Zoom

Recitations: Mon, 11:30 am – 12:30 pm online via Zoom.

Gabor Balazsi, Course PI

Course goals: The central idea of this course is the free energy, the quantitative way we understand thermodynamic forces driving the equilibria and transition rates in chemistry, physics and biology. We describe the components underpinning free energy: the entropy and internal energy. We explore the microscopic interactions - including hydrogen bonding, van der Waals interactions, electrostatics and hydrophobic forces - that explain physical and chemical mechanisms in cell biology and are the workhorse tools in computational drug discovery. We show how these basic ideas are applied: binding affinities form the basis for synthetic biology and drug discovery; coupled binding explains how biological machines convert energy and transduce signals or control gene activity; and polymer free energies form the basis for the folding of protein and RNA molecules; with implications for molecular and cellular evolution.

Textbook:          Molecular Driving Forces by Dill & Bromberg. Garland Science, 2010

Extra textbook: Protein Actions by Bahar, Jernigan & Dill. Garland Science, 2017

Extra textbook: Physical Models of Living Systems. W. H. Freeman & Co., 2015

Prior years' course syllabi: 2019, 2018, 2017, 2016, 2015, 2014


{access public}Please login to get the links to the videos{/access}

# Date Topic Reading Speaker
1 08/24 Introduction. Basic Biology. Probability, statistics MDF1, 2 Gabor Balazsi
2 08/26 Combinatorics. Distributions. Extremum principles MDF 2, 3 Gabor Balazsi
3 08/28 Energy and Multiplicity. Multivariate calculus MDF 4 Gabor Balazsi
4 08/31 Multivariate Optimization. Max Ent & Boltzmann principle MDF 5 Gabor Balazsi
5 09/02 Energies vs. Entropy formulation, thermo states MDF 6 Gabor Balazsi
6 09/04 Driving forces. Path integrals MDF 6, 7 Gabor Balazsi
  09/07 NO CLASS, Labor day    
7 09/09 Ideal Gas. Carnot cycle MDF 7 Gabor Balazsi
8 09/11 Free energies, chemical potentials MDF 8, 9 Gabor Balazsi
9 09/14 Susceptibilities. Boltzmann Law. MDF 9, 10 Gabor Balazsi
10 09/16 Partition function. Simple gases, solids MDF 10,11 Gabor Balazsi
11 09/18 Chemical equilibria MDF 12, 13 Gabor Balazsi
12 09/21

Liquids, phase equilibria. Mixtures

MDF 14, 15 Gabor Balazsi
13 09/23

Solvation

MDF 16 Gabor Balazsi
14 09/25

Diffusion, Fick's Law. Random walks. Time’s arrow

MDF 17, 18 Gabor Balazsi
15 09/28

Chemical rates. Mass-action kinetics. Transition states

MDF 19 Gabor Balazsi
16 09/30

Coulomb & electrostatics: charges, potentials, fields

MDF 20, 21 Gabor Balazsi
17 10/02

Electrochemical equilibria. Batteries

MDF 22 Gabor Balazsi
18 10/05

Salts+charges. Poisson-Boltzmann. Intermolec. forces

 MDF 23, 24  Gabor Balazsi
19 10/07

Real gas. Phase transitions. Adsorption & binding

MDF 24,25 Gabor Balazsi
  10/09

MIDTERM EXAM 1

   
20 10/12

Michaelis-Menten. Catalysis. Cooperativity

MDF 27, 28 Gabor Balazsi
21 10/14

Bio-machine principles

MDF 29 Jason Wagoner
22 10/16

Water: pure and as a solvent

MDF 30, 31 Emiliano Brini
23 10/19 Polymers 1: conformations & random flights MDF 33, 34 Helmut Strey
24 10/21 Polymers 2: polymer solutions, Flory-Huggins MDF 32, 33 Helmut Strey
25 10/23

Protein structures

PA1 Markus Seeliger
26 10/26 Protein function & mechanisms PA2 Markus Seeliger

27

10/28 Protein folding & stability PA3 Carlos Simmerling
28 10/30 Cooperativity in proteins PA5 Carlos Simmerling
29 11/02 Protein Folding on Energy Landscapes, and Aggregation PA6 Emiliano Brini
30 11/04 Protein evolution and sequence space PA7 Max Shapino
31 11/06 Bioinformatics PA8 Steve Skiena
32 11/09 Gene expression and it's regulation   Gabor Balazsi
33 11/12 Natural and synthetic gene networks   Gabor Balazsi
34 11/13 Drug discovery & methods   Dima Kozakov
35 11/16 Drug discovery in industry   John H. Van Drie, Van Drie Research, LLC
36 11/18 Research Project Presentations    
  11/20 MIDTERM EXAM 2    
  11/23 NO CLASS, Thanksgiving break    
  11/25 NO CLASS, Thanksgiving break    
  11/27 NO CLASS, Thanksgiving break    

MDF = Molecular Driving Forces, chapter numbers.
PA = Protein Actions, chapter numbers.

TAs:  TAs: Jonathan Pachter, Yuzhang Wang, Darya Stepanenko.

 

For videos, please go to Blackboard.


 

Student Accessibility Support Center Statement
If you have a physical, psychological, medical, or learning disability that may impact your course work, please contact the Student Accessibility Support Center, 128 ECC Building, (631) 632- 6748, or via e-mail at:  This email address is being protected from spambots. You need JavaScript enabled to view it.. They will determine with you what accommodations are necessary and appropriate. All information and documentation is confidential.

Academic Integrity Statement
Each student must pursue his or her academic goals honestly and be personally accountable for all submitted work. Representing another person's work as your own is always wrong. Faculty is required to report any suspected instances of academic dishonesty to the Academic Judiciary. Faculty in the Health Sciences Center (School of Health Technology & Management, Nursing, Social Welfare, Dental Medicine) and School of Medicine are required to follow their school- specific procedures. For more comprehensive information on academic integrity, including categories of academic dishonesty please refer to the academic judiciary website at http://www.stonybrook.edu/commcms/academic_integrity/index.html

Student Conduct and Community Standards
Stony Brook University expects students to respect the rights, privileges, and property of other people. Faculty are required to report to the Office of Student Conduct and Community Standards any disruptive behavior that interrupts their ability to teach, compromises the safety of the learning environment, or inhibits students' ability to learn.

Religious Observance
See the policy statement regarding religious holidays at here. Students are expected to notify the course professors by email of their intention to take time out for religious observance.  This should be done as soon as possible but definitely before the end of the add/drop period.  At that time they can discuss with the instructor(s) how they will be able to make up the work covered.

Physical and Quantitative Biology, BME/CHE/PHY 558

Fall 2021 / MWF 10:30 – 11:25 AM,  in Laufer Center rootm 101.

Recitations: Mon, 11:30 am – 12:30 pm, in Laufer Center Room 107.

Gabor Balazsi, Course PI

Course goals: The central idea of this course is the free energy, the quantitative way we understand thermodynamic forces driving the equilibria and transition rates in chemistry, physics and biology. We describe the components underpinning free energy: the entropy and internal energy. We explore the microscopic interactions - including hydrogen bonding, van der Waals interactions, electrostatics, and hydrophobic forces - that explain physical and chemical mechanisms in cell biology and are the workhorse tools in computational drug discovery. We show how these basic ideas are applied: binding affinities form the basis for synthetic biology and drug discovery; coupled binding explains how biological machines convert energy and transduce signals or control gene activity; and polymer free energies form the basis for the folding of protein and RNA molecules; with implications for molecular and cellular evolution.

Textbook:          Molecular Driving Forces by Dill & Bromberg. Garland Science, 2010

Extra textbook: Protein Actions by Bahar, Jernigan & Dill. Garland Science, 2017

Extra textbook: Physical Models of Living Systems. W. H. Freeman & Co., 2015

Prior years' course syllabi: 2020, 2019, 2018, 2017, 2016, 2015, 2014


{access public}Please login to get the links to the videos{/access}

# Date Topic Reading Speaker
1 08/23 Introduction. Basic Biology. Probability, statistics MDF1, 2 Gabor Balazsi
2 08/25 Combinatorics. Distributions. Extremum principles MDF 2, 3 Gabor Balazsi
3 08/27 Energy and Multiplicity. Multivariate calculus MDF 4 Gabor Balazsi
4 08/30 Multivariate Optimization. Max Ent & Boltzmann principle MDF 5 Gabor Balazsi
5 09/01 Energies vs. Entropy formulation, thermo states MDF 6 Gabor Balazsi
6 09/03 Driving forces. Path integrals MDF 6, 7 Gabor Balazsi
  09/06 NO CLASS, Labor day    
7 09/08 Ideal Gas. Carnot cycle MDF 7 Gabor Balazsi
8 09/10 Free energies, chemical potentials MDF 8, 9 Gabor Balazsi
9 09/13 Susceptibilities. Boltzmann Law. MDF 9, 10 Gabor Balazsi
10 09/15 Partition function. Simple gases, solids MDF 10,11 Gabor Balazsi
11 09/17 Chemical equilibria MDF 12, 13 Gabor Balazsi
12 09/20

Liquids, phase equilibria. Mixtures

MDF 14, 15 Gabor Balazsi
13 09/22

Solvation

MDF 16 Gabor Balazsi
14 09/24

Diffusion, Fick's Law. Random walks. Time’s arrow

MDF 17, 18 Gabor Balazsi
15 09/27

Chemical rates. Mass-action kinetics. Transition states

MDF 19 Gabor Balazsi
16 09/29

Coulomb & electrostatics: charges, potentials, fields

MDF 20, 21 Gabor Balazsi
17 10/01

Electrochemical equilibria. Batteries

MDF 22 Gabor Balazsi
18 10/04

Salts+charges. Poisson-Boltzmann. Intermolec. forces

 MDF 23, 24  Gabor Balazsi
19 10/06

Real gas. Phase transitions. Adsorption & binding

MDF 24,25 Gabor Balazsi
  10/08

MIDTERM EXAM 1

   
  10/11

NO CLASS, Fall Break.

   
20 10/13

Michaelis-Menten. Catalysis. Cooperativity

MDF 27, 28 Gabor Balazsi
21 10/15

Bio-machine principles

MDF 29 Jason Wagoner
22 10/18

Water: pure and as a solvent

MDF 30, 31 Marivi Fernandez-Serra
23 10/20 Polymers 1: conformations & random flights MDF 33, 34 Helmut Strey
24 10/22 Polymers 2: polymer solutions, Flory-Huggins MDF 32, 33 Helmut Strey
25 10/25

Protein structures

PA1 Markus Seeliger
26 10/27 Protein function & mechanisms PA2 Markus Seeliger

27

10/29 Protein folding & stability PA3 Carlos Simmerling
28 11/01 Cooperativity in proteins PA5 Carlos Simmerling
29 11/03 Protein Folding on Energy Landscapes, and Aggregation PA6 Roy Nassar
30 11/05 Protein evolution and sequence space PA7 Tom MacCarthy
31 11/08 Bioinformatics PA8 Steve Skiena
32 11/10 Gene expression and it's regulation   Gabor Balazsi
33 11/12 Natural and synthetic gene networks   Gabor Balazsi
34 11/15 Drug discovery & methods   Dima Kozakov
35 11/17 Drug discovery in industry   John H. Van Drie, Van Drie Research, LLC
36 11/19 Research Project Presentations    
  11/22 MIDTERM EXAM 2    
  11/24 NO CLASS, Thanksgiving break    
  11/26 NO CLASS, Thanksgiving break    

MDF = Molecular Driving Forces, chapter numbers.
PA = Protein Actions, chapter numbers.

TAs:  TAs: Gregory Dignon, Christopher Foran.

 

For videos, please go to Blackboard.


 

Student Accessibility Support Center Statement
If you have a physical, psychological, medical, or learning disability that may impact your course work, please contact the Student Accessibility Support Center, 128 ECC Building, (631) 632- 6748, or via e-mail at:  This email address is being protected from spambots. You need JavaScript enabled to view it.. They will determine with you what accommodations are necessary and appropriate. All information and documentation is confidential.

Academic Integrity Statement
Each student must pursue his or her academic goals honestly and be personally accountable for all submitted work. Representing another person's work as your own is always wrong. Faculty is required to report any suspected instances of academic dishonesty to the Academic Judiciary. Faculty in the Health Sciences Center (School of Health Technology & Management, Nursing, Social Welfare, Dental Medicine) and School of Medicine are required to follow their school- specific procedures. For more comprehensive information on academic integrity, including categories of academic dishonesty please refer to the academic judiciary website at http://www.stonybrook.edu/commcms/academic_integrity/index.html

Student Conduct and Community Standards
Stony Brook University expects students to respect the rights, privileges, and property of other people. Faculty are required to report to the Office of Student Conduct and Community Standards any disruptive behavior that interrupts their ability to teach, compromises the safety of the learning environment, or inhibits students' ability to learn.

Religious Observance
See the policy statement regarding religious holidays at here. Students are expected to notify the course professors by email of their intention to take time out for religious observance.  This should be done as soon as possible but definitely before the end of the add/drop period.  At that time they can discuss with the instructor(s) how they will be able to make up the work covered.

Physical and Quantitative Biology, BME/CHE/PHY 558

Fall 2022 / MWF 10:30 – 11:25 AM,  in Laufer Center rootm 101.

Recitations: Mon, 11:30 am – 12:30 pm, in Laufer Center Room 101.

Gabor Balazsi, Course PI

Course goals: The central idea of this course is the free energy, the quantitative way we understand thermodynamic forces driving the equilibria and transition rates in chemistry, physics and biology. We describe the components underpinning free energy: the entropy and internal energy. We explore the microscopic interactions - including hydrogen bonding, van der Waals interactions, electrostatics and hydrophobic forces - that explain physical and chemical mechanisms in cell biology and are the workhorse tools in computational drug discovery. We show how these basic ideas are applied: binding affinities form the basis for synthetic biology and drug discovery; coupled binding explains how biological machines convert energy and transduce signals or control gene activity; and polymer free energies form the basis for the folding of protein and RNA molecules; with implications for molecular and cellular evolution.

Textbook:          Molecular Driving Forces by Dill & Bromberg. Garland Science, 2010

Extra textbook: Protein Actions by Bahar, Jernigan & Dill. Garland Science, 2017

Extra textbook: Physical Models of Living Systems. W. H. Freeman & Co., 2015

Prior years' course syllabi: 2021, 2020, 2019, 2018, 2017, 2016, 2015, 2014


{access public}Please login to get the links to the videos{/access}

# Date Topic Reading Speaker
1 08/22 Introduction. Basic Biology. Probability, statistics MDF1, 2 Gabor Balazsi
2 08/24 Combinatorics. Distributions. Extremum principles MDF 2, 3 Gabor Balazsi
3 08/26 Energy and Multiplicity. Multivariate calculus MDF 4 Gabor Balazsi
4 08/29 Multivariate Optimization. Max Ent & Boltzmann principle MDF 5 Gabor Balazsi (TA: JP)
5 08/31 Energies vs. Entropy formulation, thermo states MDF 6 Gabor Balazsi
6 09/02 Driving forces. Path integrals MDF 6, 7 Gabor Balazsi
  09/05 NO CLASS, Labor day    
7 09/07 Ideal Gas. Carnot cycle MDF 7 Gabor Balazsi (TA: JP)
8 09/09 Free energies, chemical potentials MDF 8, 9 Gabor Balazsi
9 09/12 Susceptibilities. Boltzmann Law. MDF 9, 10 Gabor Balazsi (TA: JP)
10 09/14 Partition function. Simple gases, solids MDF 10,11 Gabor Balazsi
11 09/16 Chemical equilibria MDF 12, 13 Gabor Balazsi
12 09/19

Liquids, phase equilibria. Mixtures

MDF 14, 15 Gabor Balazsi (TA: JP)
13 09/21

Solvation

MDF 16 Gabor Balazsi
14 09/23

Diffusion, Fick's Law. Random walks. Time’s arrow

MDF 17, 18 Gabor Balazsi
15 09/26

Chemical rates. Mass-action kinetics. Transition states

MDF 19 Gabor Balazsi (TA: JP)
16 09/28

Coulomb & electrostatics: charges, potentials, fields

MDF 20, 21 Gabor Balazsi
17 09/30

Electrochemical equilibria. Batteries

MDF 22 Gabor Balazsi
18 10/03

Salts+charges. Poisson-Boltzmann. Intermolec. forces

 MDF 23, 24  Gabor Balazsi (TA: JP)
19 10/05

Real gas. Phase transitions. Adsorption & binding

MDF 24,25 Gabor Balazsi
  10/07

MIDTERM EXAM 1

   
  10/10

NO CLASS, Fall Break.

   
20 10/12

Michaelis-Menten. Catalysis. Cooperativity

MDF 27, 28 Gabor Balazsi (TA: CK)
21 10/14

Bio-machine principles

MDF 29 Jason Wagoner
22 10/17

Water: pure and as a solvent

MDF 30, 31 Marivi Fernandez-Serra (TA: CK)
23 10/19 Polymers 1: conformations & random flights MDF 33, 34 Helmut Strey
24 10/21 Polymers 2: polymer solutions, Flory-Huggins MDF 32, 33 Helmut Strey
25 10/24

Protein structures

PA1 Markus Seeliger (TA: CK)
26 10/26 Protein function & mechanisms PA2 Markus Seeliger

27

10/28 Protein folding & stability PA3 Carlos Simmerling
28 10/31 Cooperativity in proteins PA5 Carlos Simmerling (TA: CK)
29 11/02 Protein Folding on Energy Landscapes, and Aggregation PA6 Rostam Razban
30 11/04 Protein evolution and sequence space PA7 Tom MacCarthy
31 11/07 Bioinformatics PA8 Dominik Kempa (TA: CK)
32 11/09 Gene expression and it's regulation   Gabor Balazsi
33 11/11 Natural and synthetic gene networks   Gabor Balazsi
34 11/14 Drug discovery & methods   Dima Kozakov (TA: CK)
35 11/16 Drug discovery in industry   John H. Van Drie, Van Drie Research, LLC
36 11/18 Research Project Presentations    
  11/21 MIDTERM EXAM 2    
  11/23 NO CLASS, Thanksgiving break    
  11/25 NO CLASS, Thanksgiving break    

MDF = Molecular Driving Forces, chapter numbers.
PA = Protein Actions, chapter numbers.

TAs:  TAs: Jonathan Pachter(JP), Charles Kocher(CK).

 

For videos, please go to Blackboard.


 

Student Accessibility Support Center Statement
If you have a physical, psychological, medical, or learning disability that may impact your course work, please contact the Student Accessibility Support Center, 128 ECC Building, (631) 632- 6748, or via e-mail at:  This email address is being protected from spambots. You need JavaScript enabled to view it.. They will determine with you what accommodations are necessary and appropriate. All information and documentation is confidential.

Academic Integrity Statement
Each student must pursue his or her academic goals honestly and be personally accountable for all submitted work. Representing another person's work as your own is always wrong. Faculty is required to report any suspected instances of academic dishonesty to the Academic Judiciary. Faculty in the Health Sciences Center (School of Health Technology & Management, Nursing, Social Welfare, Dental Medicine) and School of Medicine are required to follow their school- specific procedures. For more comprehensive information on academic integrity, including categories of academic dishonesty please refer to the academic judiciary website at http://www.stonybrook.edu/commcms/academic_integrity/index.html

Student Conduct and Community Standards
Stony Brook University expects students to respect the rights, privileges, and property of other people. Faculty are required to report to the Office of Student Conduct and Community Standards any disruptive behavior that interrupts their ability to teach, compromises the safety of the learning environment, or inhibits students' ability to learn.

Religious Observance
See the policy statement regarding religious holidays at here. Students are expected to notify the course professors by email of their intention to take time out for religious observance.  This should be done as soon as possible but definitely before the end of the add/drop period.  At that time they can discuss with the instructor(s) how they will be able to make up the work covered.

Physical and Quantitative Biology, BME/CHE/PHY 558

Fall 2018 / MWF 10 – 10:53 AM in Laufer Center 101

Recitations: Mon, 11:00 am – 12:00 pm in Laufer Center 107.

Gabor Balazsi, Course PI

Course goals: The central idea of this course is the free energy, the quantitative way we understand thermodynamic forces driving the equilibria and transition rates in chemistry, physics and biology. We describe the components underpinning free energy: the entropy and internal energy. We explore the microscopic interactions - including hydrogen bonding, van der Waals interactions, electrostatics and hydrophobic forces - that explain physical and chemical mechanisms in cell biology and are the workhorse tools in computational drug discovery. We show how these basic ideas are applied: binding affinities form the basis for synthetic biology and drug discovery; coupled binding explains how biological machines convert energy and transduce signals or control gene activity; and polymer free energies form the basis for the folding of protein and RNA molecules; with implications for molecular and cellular evolution.

Textbook:          Molecular Driving Forces by Dill & Bromberg. Garland Science, 2010

Extra textbook: Protein Actions by Bahar, Jernigan & Dill. Garland Science, 2017

Prior years' course syllabi: 2017, 2016, 2015, 2014


{access public}Please login to get the links to the videos{/access}

# Date Topic Reading Speaker
1 08/27 Introduction. Basic Biology. Probability, statistics MDF1, 2 Gabor Balazsi
2 08/29 Combinatorics. Distributions. Extremum principles MDF 2, 3 Gabor Balazsi
3 08/31 Energy and Multiplicity. Multivariate calculus MDF 4 Gabor Balazsi
  09/03 NO CLASS, Labor day    
4 09/05 Multivariate Optimization. Max Ent & Boltzmann principle MDF 5 Gabor Balazsi
5 09/07 Energies vs. Entropy formulation, thermo states MDF 6 Gabor Balazsi
6 09/10 Free energies, chemical potentials MDF 8, 9 Gabor Balazsi
7 09/12 Microscopic modeling & Boltzmann Law MDF 10 Gabor Balazsi
8 09/14 Equilibrium constants, binding affinities MDF 13 Gabor Balazsi
9 09/17 Liquids, phase equilibria MDF 14 Gabor Balazsi
10 09/19 Solvation, free energies of transfer MDF 15,16 Gabor Balazsi
11 09/21 Diffusion, Fick's Law, Physical Dynamics MDF 17, 18 Gabor Balazsi
12 09/24

Chemical rates.  Mass-action kinetics

MDF 19 Gabor Balazsi
13 09/26

Transition states & activation processes

MDF 19 Gabor Balazsi
14 09/28

Coulomb & electrostatics: how charges interact

MDF 20 Gabor Balazsi
15 10/01

Electrostatic potentials

MDF 21 Gabor Balazsi
16 10/03

Electrochemical equilibria, batteries

MDF 22 Gabor Balazsi
17 10/05

Salts shield charges. Poisson-Boltzmann

MDF 23 Gabor Balazsi
18 10/08

NO CLASS, Fall Break/Columbus Day

   
19 10/10

Intermolecular interactions, Phase transitions

MDF 24,25 Gabor Balazsi
20 10/12

Adsorption & binding, Michaelis-Menten, catalysis

MDF 27 Gabor Balazsi
  10/15

MIDTERM EXAM

   
21 10/17 Binding cooperativity  MDF 28 Gabor Balazsi
22 10/19 Polymers 1: conformations & random flights MDF 33, 34 Helmut Strey
23 10/22 Polymers 2: polymer solutions, Flory-Huggins MDF 32, 33 Helmut Strey
24 10/24

Bio-machine principles

MDF 29 Jason Wagoner
25 10/26

Water: pure and as a solvent

MDF 30, 31 Emiliano Brini
26 10/29

Protein structures

PA1 Markus Seeliger
27 10/31 Protein function & mechanisms PA2 Markus Seeliger

28

11/02 Protein folding & stability PA3 James Robertson
29 11/05 Cooperativity in proteins PA5 Emiliano Brini
30 11/07 Folding on Energy Landscapes, and Aggregation PA6 Emiliano Brini
31 11/09 Protein evolution and sequence space PA7 Max Shapino
32 11/12 Bioinformatics PA8 Rob Patro
33 11/14 Gene expression and it's regulation   Gabor Balazsi
34 11/16 Natural and synthetic gene networks   Gabor Balazsi
35 11/19 Drug discovery & methods   Dima Kozakov
  11/22 NO CLASS, Thanksgiving break    
  11/24 NO CLASS, Thanksgiving break    
  11/26 Drug discovery in industry   John H. Van Drie, Van Drie Research, LLC
36 11/28 Research Project Presentations    
  11/30 FINAL EXAM    

MDF = Molecular Driving Forces, chapter numbers.
PA = Protein Actions, chapter numbers.

TAs:  Luca Agozzino (#1 - #20), Roy Nassar (#21 - #36).


 

ACADEMIC INTEGRITY
Each student must pursue his or her academic goals honestly and be personally accountable for all submitted work. Representing another person¹s work as your own is always wrong. Any suspected instance of academic dishonesty will be reported to the Academic Judiciary. For more comprehensive information on academic integrity, including categories of academic dishonesty, please refer to the academic judiciary website at http://www.stonybrook.edu/uaa/academicjudiciary/

ELECTRONIC COMMUNICATION
Email to your University email account is an important way of communicating with you for this course.  For most students the email address is This email address is being protected from spambots. You need JavaScript enabled to view it.¹, and the account can be accessed here: http://www.stonybrook.edu/mycloud.  *It is your responsibility to read your email received at this account.*

For instructions about how to verify your University email address see this: http://it.stonybrook.edu/help/kb/checking-or-changing-your-mail-forwarding-address-in-the-epo. You can set up email forwarding using instructions here: http://it.stonybrook.edu/help/kb/setting-up-mail-forwarding-in-google-mail. If you choose to forward your University email to another account, we are not responsible for any undeliverable messages.

RELIGIOUS OBSERVANCES
See the policy statement regarding religious holidays at http://www.stonybrook.edu/registrar/forms/RelHolPol%20081612%20cr.pdf

Students are expected to notify the course professors by email of their intention to take time out for religious observance.  This should be done as soon as possible but definitely before the end of the add/drop¹ period.  At that time they can discuss with the instructor(s) how they will be able to make up the work covered.


DISABILITIES
If you have a physical, psychiatric/emotional, medical or learning disability that may impact on your ability to carry out assigned course work, you should contact the staff in the Disability Support Services office [DSS], 632-6748/9. DSS will review your concerns and determine, with you, what accommodations are necessary and appropriate. All information and documentation of disability is confidential. Students who require assistance during emergency evacuation are encouraged to discuss their needs with their professors and Disability Support Services. For procedures and information go to the website: http://www.sunysb.edu/ehs/fire/disabilities.shtml.

CRITICAL INCIDENT MANAGEMENT
Stony Brook University expects students to respect the rights, privileges, and property of other people. Faculty are required to report to the University Police and the Office of University Community Standards any serious disruptive behavior that interrupts teaching, compromises the safety of the learning environment, and/or inhibits students¹ ability to learn. See more here: http://www.stonybrook.edu/sb/behavior.shtml

 

 

Physical and Quantitative Biology, BME/CHE/PHY 558

Fall 2017 / MWF 10 – 10:50 AM in Laufer Center 101

Gabor Balazsi, Course PI

Course goals: The central idea of this course is the free energy, the quantitative way we understand thermodynamic forces driving the equilibria and transition rates in chemistry, physics and biology. We describe the components underpinning free energy: the entropy and internal energy. We explore the microscopic interactions - including hydrogen bonding, van der Waals interactions, electrostatics and hydrophobic forces - that explain physical and chemical mechanisms in cell biology and are the workhorse tools in computational drug discovery. We show how these basic ideas are applied: binding affinities form the basis for synthetic biology and drug discovery; coupled binding explains how biological machines convert energy and transduce signals or regulate gene activity; and polymer free energies form the basis for the folding of protein and RNA molecules.

Textbook:          Molecular Driving Forces by Dill & Bromberg. Garland Science, 2010

Extra textbook: Protein Actions by Bahar, Jernigan & Dill. Garland Science, 2017

Prior years' course syllabi: 2016, 2015, 2014


{access public}Please login to get the links to the videos{/access}

# Date Topic Reading Speaker
1 08/28 Introduction. Basic Biology. Probability, statistics
[watch video: {access !Public}here{/access}] [Slides]
MDF1, 2 Gabor Balazsi
2 08/30 Combinatorics. Distributions. Extremum principles
[watch video: {access !public}here{/access}] [Slides]
MDF 2, 3 Gabor Balazsi
3 09/01 Energy and Multiplicity. Multivariate calculus
[watch video: {access !public}here{/access}] [Slides]
MDF 4 Gabor Balazsi
  09/04 NO CLASS, Labor day    
4 09/06 Multivariate Optimization. Max Ent & Boltzmann principle
[watch video: {access !public}here{/access}] [Slides]
MDF 5 Gabor Balazsi
5 09/08 Energies vs. Entropy formulation, thermo states
[watch video: {access !public}here{/access}] [Slides]
MDF 6 Gabor Balazsi
6 09/11 Free energies, chemical potentials
[watch video: {access !public}here{/access}] [Slides]
MDF 8, 9 Gabor Balazsi
7 09/13 Microscopic modeling & Boltzmann Law
[watch video: {access !public}here{/access}] [Slides]
MDF 10 Gabor Balazsi
8 09/15 Equilibrium constants, binding affinities
[watch video: {access !public}here{/access}] [Slides]
MDF 13 Gabor Balazsi
9 09/18 Liquids, phase equilibria
[watch video: {access !public}here{/access}] [Slides]
MDF 14 Gabor Balazsi
10 09/20 Solvation, free energies of transfer
[watch video: {access !public}here{/access}] [Slides]
MDF 15,16 Gabor Balazsi
11 09/22 Diffusion, Fick's Law, Physical Dynamics
[watch video: {access !public}here{/access}] [Slides]
MDF 17, 18 Gabor Balazsi
12 09/25

Chemical rates.  Mass-action kinetics
[watch video: {access !public}here{/access}] [Slides]

MDF 19 Gabor Balazsi
13 09/27

Transition states & activation processes
[watch video: {access !public}here{/access}] [Slides]

MDF 19 Gabor Balazsi
14 09/29

Coulomb & electrostatics: how charges interact
[watch video: {access !public}here{/access}] [Slides]

MDF 20 Gabor Balazsi
15 10/02

Electrostatic potentials
[watch video: {access !public}here{/access}] [Slides]

MDF 21 Gabor Balazsi
16 10/04

Electrochemical equilibria, batteries
[watch video: {access !public}here{/access}] [Slides]

MDF 22 Gabor Balazsi
17 10/06

Salts shield charges. Poisson-Boltzmann
[watch video: {access !public}here{/access}] [Slides]

MDF 23 Gabor Balazsi
18 10/09

Intermolecular interactions
[watch video: {access !public}here{/access}] [Slides]

MDF 24 Gabor Balazsi
19 10/11

Phase transitions
[watch video: {access !public}here{/access}] [Slides]

MDF 25 Gabor Balazsi
20 10/13

Adsorption & binding, Michaelis-Menten, catalysis
[watch video: {access !public}here{/access}] [Slides]

MDF 27 Gabor Balazsi
  10/16

MIDTERM EXAM

   
21 10/18 Binding cooperativity
[watch video: {access !public}here{/access}] [Slides]
 MDF 28  Gabor Balazsi
22 10/20 Polymers 1: conformations & random flights
[watch video: {access !public}here{/access}] [Slides]
MDF 33, 34 Helmut Strey
23 10/23 Polymers 2: polymer solutions, Flory-Huggins
[watch video: {access !public}here{/access}] [Slides]
MDF 32, 33 Helmut Strey
24 10/25

Bio-machine principles
[watch video: {access !public}here{/access}] [Slides]

MDF 29 Adam de Graff
25 10/27

Water: pure and as a solvent
[watch video: {access !public}here{/access}] [Slides]

MDF 30, 31 Emiliano Brini
26 10/30

Protein structures
[watch video: {access !public}here{/access}] [Slides]

PA1 Markus Seeliger
27 11/01 Protein function & mechanisms
[watch video: {access !public}here{/access}] [Slides]
PA2 Markus Seeliger

28

11/03 Protein folding & stability
[watch video: {access !public}here{/access}] [Slides]
PA3 James Robertson
29 11/06 Cooperativity in proteins
[watch video: {access !public}here{/access}] [Slides]
PA5 Emiliano Brini
30 11/08 Protein folding: kinetics, Landscapes, and Aggregation
[watch video: {access !public}here{/access}] [Slides]
PA6 Emiliano Brini
31 11/10 Protein evolution and sequence space
[watch video: {access !public}here{/access}] [Slides]
PA7 Alberto Perez
32 11/13 Bioinformatics
[watch video: {access !public}here{/access}] [Slides]
PA8 Rob Patro
33 11/15 Gene expression and it's regulation
[watch video: {access !public}here{/access}] [Slides]
  Gabor Balazsi
34 11/17 Natural and synthetic gene networks
[watch video: {access !public}here{/access}] [Slides]
  Gabor Balazsi
35 11/20 Drug discovery & methods
[watch video: {access !public}here{/access}] [Slides]
  Dima Kozakov
  11/22 NO CLASS, Thanksgiving break    
  11/24 NO CLASS, Thanksgiving break    
  11/27 Research Project Presentations    
 36 11/29 Drug discovery in industry    John H. Van Drie, Van Drie Research, LLC
  12/01 FINAL EXAM    

MDF = Molecular Driving Forces, chapter numbers.
PA = Protein Actions, chapter numbers.

TAs: Michael Cortes (#1 - #20). Chuan Tian, Bihua Yu and Cong Liu (#21 - #36).


 

ACADEMIC INTEGRITY
Each student must pursue his or her academic goals honestly and be personally accountable for all submitted work. Representing another person¹s work as your own is always wrong. Any suspected instance of academic dishonesty will be reported to the Academic Judiciary. For more comprehensive information on academic integrity, including categories of academic dishonesty, please refer to the academic judiciary website at http://www.stonybrook.edu/uaa/academicjudiciary/

ELECTRONIC COMMUNICATION
Email to your University email account is an important way of communicating with you for this course.  For most students the email address is This email address is being protected from spambots. You need JavaScript enabled to view it.¹, and the account can be accessed here: http://www.stonybrook.edu/mycloud.  *It is your responsibility to read your email received at this account.*

For instructions about how to verify your University email address see this: http://it.stonybrook.edu/help/kb/checking-or-changing-your-mail-forwarding-address-in-the-epo. You can set up email forwarding using instructions here: http://it.stonybrook.edu/help/kb/setting-up-mail-forwarding-in-google-mail. If you choose to forward your University email to another account, we are not responsible for any undeliverable messages.

RELIGIOUS OBSERVANCES
See the policy statement regarding religious holidays at http://www.stonybrook.edu/registrar/forms/RelHolPol%20081612%20cr.pdf

Students are expected to notify the course professors by email of their intention to take time out for religious observance.  This should be done as soon as possible but definitely before the end of the add/drop¹ period.  At that time they can discuss with the instructor(s) how they will be able to make up the work covered.


DISABILITIES
If you have a physical, psychiatric/emotional, medical or learning disability that may impact on your ability to carry out assigned course work, you should contact the staff in the Disability Support Services office [DSS], 632-6748/9. DSS will review your concerns and determine, with you, what accommodations are necessary and appropriate. All information and documentation of disability is confidential. Students who require assistance during emergency evacuation are encouraged to discuss their needs with their professors and Disability Support Services. For procedures and information go to the website: http://www.sunysb.edu/ehs/fire/disabilities.shtml.

CRITICAL INCIDENT MANAGEMENT
Stony Brook University expects students to respect the rights, privileges, and property of other people. Faculty are required to report to the University Police and the Office of University Community Standards any serious disruptive behavior that interrupts teaching, compromises the safety of the learning environment, and/or inhibits students¹ ability to learn. See more here: http://www.stonybrook.edu/sb/behavior.shtml